Match Partial charge 1
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-serial-full: [foss2023b-serial] >
Input 20-eigensolver.05-rmmdiis.inp
Value | Reference | Precision | Status |
4.157000000000000e+00 | 4.157000000000000e+00 | 2.080000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Partial ionic charges', 3, 2)